BDBM653473 (P)-(7S)-4-(2-methylphenyl)-7-(4-methyl- 1,3-thiazol-5-yl)-2-(2-(2-propenoyl)-2,6- diazaspiro[3.4]octan-6-yl)-5,6,7,8- tetrahydro-3-quinolinecarbonitrile (3rd eluting isomer)::US20240059703, Example 23-4::US20240059703, Example 23-6

SMILES C=CC(=O)N1CC2(CCN(c3nc4c(c(-c5ccccc5C)c3C#N)CC[C@H](c3scnc3C)C4)C2)C1

InChI Key InChIKey=VZOIBBRJWWMLSQ-UHFFFAOYSA-N

Data  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 653473   

LigandChemical structure of BindingDB Monomer ID 653473BDBM653473(US20240059703, Example 23-4 | US20240059703, Examp...)
Affinity DataIC50: 19nMAssay Description:Purified GDP-bound KRAS protein (aa 1-169), containing both G12C and C118A amino acid substitutions and an N-terminal His-tag, was pre-incubated in a...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/24/2024
Entry Details
US Patent

LigandChemical structure of BindingDB Monomer ID 653473BDBM653473(US20240059703, Example 23-4 | US20240059703, Examp...)
Affinity DataIC50: 128nMAssay Description:Purified GDP-bound KRAS protein (aa 1-169), containing both G12C and C118A amino acid substitutions and an N-terminal His-tag, was pre-incubated in a...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/24/2024
Entry Details
US Patent